ChemSpider 2D Image | 1,3-DILAURYL CITRATE | C30H56O7

1,3-DILAURYL CITRATE

  • Molecular FormulaC30H56O7
  • Average mass528.761 Da
  • Monoisotopic mass528.402588 Da
  • ChemSpider ID105067

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1,2,3-Propanetricarboxylic acid, 2-hydroxy-, 1,3-didodecyl ester [ACD/Index Name]
1,3-DILAURYL CITRATE
4-(Dodecyloxy)-2-[2-(dodecyloxy)-2-oxoethyl]-2-hydroxy-4-oxobutanoic acid [ACD/IUPAC Name]
4-(Dodecyloxy)-2-[2-(dodecyloxy)-2-oxoethyl]-2-hydroxy-4-oxobutansäure [German] [ACD/IUPAC Name]
887620-32-8 [RN]
Acide 4-(dodécyloxy)-2-[2-(dodécyloxy)-2-oxoéthyl]-2-hydroxy-4-oxobutanoïque [French] [ACD/IUPAC Name]
25637-88-1 [RN]
26297-82-5 [RN]
2-hydroxy-4-keto-2-(2-keto-2-lauryloxy-ethyl)-4-lauryloxy-butyric acid
4-dodecoxy-2-(2-dodecoxy-2-oxoethyl)-2-hydroxy-4-oxobutanoic acid
More...

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

T578429LAN [DBID]
UNII:T578429LAN [DBID]
UNII-T578429LAN [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.0±0.1 g/cm3
Boiling Point: 634.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.2 mmHg at 25°C
Enthalpy of Vaporization: 107.5±6.0 kJ/mol
Flash Point: 190.4±25.0 °C
Index of Refraction: 1.477
Molar Refractivity: 147.6±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 29
#Rule of 5 Violations: 2
ACD/LogP: 11.72
ACD/LogD (pH 5.5): 7.82
ACD/BCF (pH 5.5): 106014.29
ACD/KOC (pH 5.5): 20869.95
ACD/LogD (pH 7.4): 6.99
ACD/BCF (pH 7.4): 15535.62
ACD/KOC (pH 7.4): 3058.34
Polar Surface Area: 110 Å2
Polarizability: 58.5±0.5 10-24cm3
Surface Tension: 39.3±3.0 dyne/cm
Molar Volume: 522.9±3.0 cm3

Click to predict properties on the Chemicalize site


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